1-[3-(2-bicyclo[2.2.1]heptanylmethoxy)phenyl]butan-1-ol;1-butyl-3-(cyclobutylmethoxy)benzene;1-butyl-3-(cyclopentylmethoxy)benzene;1-(cyclohexylmethoxy)-3-pentan-2-ylbenzene;(1R)-1-[3-(cyclohexylmethoxy)phenyl]-2-ethylbutan-1-ol;(1S,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1S,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopropylmethoxy)phenyl]butan-1-ol;[3-[(2R)-2-methylbutyl]phenoxy]methylcyclooctane

C192H294O18 — CID 162195199

IUPAC1-[3-(2-bicyclo[2.2.1]heptanylmethoxy)phenyl]butan-1-ol;1-butyl-3-(cyclobutylmethoxy)benzene;1-butyl-3-(cyclopentylmethoxy)benzene;1-(cyclohexylmethoxy)-3-pentan-2-ylbenzene;(1R)-1-[3-(cyclohexylmethoxy)phenyl]-2-ethylbutan-1-ol;(1S,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1S,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopropylmethoxy)phenyl]butan-1-ol;[3-[(2R)-2-methylbutyl]phenoxy]methylcyclooctane
SMILESCCC(CC)[C@@H](O)c1cccc(OCC2CCCCC2)c1.CCCC(C)c1cccc(OCC2CCCCC2)c1.CCCC(O)c1cccc(OCC2CC2)c1.CCCC(O)c1cccc(OCC2CC3CCC2C3)c1.CCCCc1cccc(OCC2CCC2)c1.CCCCc1cccc(OCC2CCCC2)c1.CC[C@@H](C)Cc1cccc(OCC2CCCCCCC2)c1.CC[C@@H](C)[C@@H](O)c1cccc(OCC2CCCCC2)c1.CC[C@@H](C)[C@H](O)c1cccc(OCC2CCCCC2)c1.CC[C@H](C)[C@@H](O)c1cccc(OCC2CCCCC2)c1.CC[C@H](C)[C@H](O)c1cccc(OCC2CCCCC2)c1
InChIInChI=1S/C20H32O.C19H30O2.C18H26O2.4C18H28O2.C18H28O.C16H24O.C15H22O.C14H20O2/c1-3-17(2)14-19-12-9-13-20(15-19)21-16-18-10-7-5-4-6-8-11-18;1-3-16(4-2)19(20)17-11-8-12-18(13-17)21-14-15-9-6-5-7-10-15;1-2-4-18(19)15-5-3-6-17(11-15)20-12-16-10-13-7-8-14(16)9-13;4*1-3-14(2)18(19)16-10-7-11-17(12-16)20-13-15-8-5-4-6-9-15;1-3-8-15(2)17-11-7-12-18(13-17)19-14-16-9-5-4-6-10-16;1-2-3-7-14-10-6-11-16(12-14)17-13-15-8-4-5-9-15;1-2-3-6-13-7-5-10-15(11-13)16-12-14-8-4-9-14;1-2-4-14(15)12-5-3-6-13(9-12)16-10-11-7-8-11/h9,12-13,15,17-18H,3-8,10-11,14,16H2,1-2H3;8,11-13,15-16,19-20H,3-7,9-10,14H2,1-2H3;3,5-6,11,13-14,16,18-19H,2,4,7-10,12H2,1H3;4*7,10-12,14-15,18-19H,3-6,8-9,13H2,1-2H3;7,11-13,15-16H,3-6,8-10,14H2,1-2H3;6,10-12,15H,2-5,7-9,13H2,1H3;5,7,10-11,14H,2-4,6,8-9,12H2,1H3;3,5-6,9,11,14-15H,2,4,7-8,10H2,1H3/t17-;19-;;2*14-,18+;2*14-,18-;;;;/m11.1010..../s1
InChIKeyZQVPPHGZTMIWID-PHRUSRNHSA-N
MW2890.45 g/mol
LogP52.03
Rot. Bonds67

About 1-[3-(2-bicyclo[2.2.1]heptanylmethoxy)phenyl]butan-1-ol;1-butyl-3-(cyclobutylmethoxy)benzene;1-butyl-3-(cyclopentylmethoxy)benzene;1-(cyclohexylmethoxy)-3-pentan-2-ylbenzene;(1R)-1-[3-(cyclohexylmethoxy)phenyl]-2-ethylbutan-1-ol;(1S,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1S,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopropylmethoxy)phenyl]butan-1-ol;[3-[(2R)-2-methylbutyl]phenoxy]methylcyclooctane

1-[3-(2-bicyclo[2.2.1]heptanylmethoxy)phenyl]butan-1-ol;1-butyl-3-(cyclobutylmethoxy)benzene;1-butyl-3-(cyclopentylmethoxy)benzene;1-(cyclohexylmethoxy)-3-pentan-2-ylbenzene;(1R)-1-[3-(cyclohexylmethoxy)phenyl]-2-ethylbutan-1-ol;(1S,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1S,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopropylmethoxy)phenyl]butan-1-ol;[3-[(2R)-2-methylbutyl]phenoxy]methylcyclooctane (PubChem CID 162195199) has the molecular formula C192H294O18 and a molecular weight of 2890.45 g/mol. Its IUPAC name is 1-[3-(2-bicyclo[2.2.1]heptanylmethoxy)phenyl]butan-1-ol;1-butyl-3-(cyclobutylmethoxy)benzene;1-butyl-3-(cyclopentylmethoxy)benzene;1-(cyclohexylmethoxy)-3-pentan-2-ylbenzene;(1R)-1-[3-(cyclohexylmethoxy)phenyl]-2-ethylbutan-1-ol;(1S,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1S,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopropylmethoxy)phenyl]butan-1-ol;[3-[(2R)-2-methylbutyl]phenoxy]methylcyclooctane.

Molecular Properties

Compound Name1-[3-(2-bicyclo[2.2.1]heptanylmethoxy)phenyl]butan-1-ol;1-butyl-3-(cyclobutylmethoxy)benzene;1-butyl-3-(cyclopentylmethoxy)benzene;1-(cyclohexylmethoxy)-3-pentan-2-ylbenzene;(1R)-1-[3-(cyclohexylmethoxy)phenyl]-2-ethylbutan-1-ol;(1S,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1S,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopropylmethoxy)phenyl]butan-1-ol;[3-[(2R)-2-methylbutyl]phenoxy]methylcyclooctane
PubChem CID162195199
Molecular FormulaC192H294O18
Molecular Weight2890.45 g/mol
Exact Mass2888.21
IUPAC Name1-[3-(2-bicyclo[2.2.1]heptanylmethoxy)phenyl]butan-1-ol;1-butyl-3-(cyclobutylmethoxy)benzene;1-butyl-3-(cyclopentylmethoxy)benzene;1-(cyclohexylmethoxy)-3-pentan-2-ylbenzene;(1R)-1-[3-(cyclohexylmethoxy)phenyl]-2-ethylbutan-1-ol;(1S,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1S,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopropylmethoxy)phenyl]butan-1-ol;[3-[(2R)-2-methylbutyl]phenoxy]methylcyclooctane
SMILESCCC(CC)[C@@H](O)c1cccc(OCC2CCCCC2)c1.CCCC(C)c1cccc(OCC2CCCCC2)c1.CCCC(O)c1cccc(OCC2CC2)c1.CCCC(O)c1cccc(OCC2CC3CCC2C3)c1.CCCCc1cccc(OCC2CCC2)c1.CCCCc1cccc(OCC2CCCC2)c1.CC[C@@H](C)Cc1cccc(OCC2CCCCCCC2)c1.CC[C@@H](C)[C@@H](O)c1cccc(OCC2CCCCC2)c1.CC[C@@H](C)[C@H](O)c1cccc(OCC2CCCCC2)c1.CC[C@H](C)[C@@H](O)c1cccc(OCC2CCCCC2)c1.CC[C@H](C)[C@H](O)c1cccc(OCC2CCCCC2)c1
InChIInChI=1S/C20H32O.C19H30O2.C18H26O2.4C18H28O2.C18H28O.C16H24O.C15H22O.C14H20O2/c1-3-17(2)14-19-12-9-13-20(15-19)21-16-18-10-7-5-4-6-8-11-18;1-3-16(4-2)19(20)17-11-8-12-18(13-17)21-14-15-9-6-5-7-10-15;1-2-4-18(19)15-5-3-6-17(11-15)20-12-16-10-13-7-8-14(16)9-13;4*1-3-14(2)18(19)16-10-7-11-17(12-16)20-13-15-8-5-4-6-9-15;1-3-8-15(2)17-11-7-12-18(13-17)19-14-16-9-5-4-6-10-16;1-2-3-7-14-10-6-11-16(12-14)17-13-15-8-4-5-9-15;1-2-3-6-13-7-5-10-15(11-13)16-12-14-8-4-9-14;1-2-4-14(15)12-5-3-6-13(9-12)16-10-11-7-8-11/h9,12-13,15,17-18H,3-8,10-11,14,16H2,1-2H3;8,11-13,15-16,19-20H,3-7,9-10,14H2,1-2H3;3,5-6,11,13-14,16,18-19H,2,4,7-10,12H2,1H3;4*7,10-12,14-15,18-19H,3-6,8-9,13H2,1-2H3;7,11-13,15-16H,3-6,8-10,14H2,1-2H3;6,10-12,15H,2-5,7-9,13H2,1H3;5,7,10-11,14H,2-4,6,8-9,12H2,1H3;3,5-6,9,11,14-15H,2,4,7-8,10H2,1H3/t17-;19-;;2*14-,18+;2*14-,18-;;;;/m11.1010..../s1
InChIKeyZQVPPHGZTMIWID-PHRUSRNHSA-N
XLogP52.03
TPSA243.14 Ų
H-Bond Donors7
H-Bond Acceptors18
Rotatable Bonds67
Heavy Atoms210
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002890.45
LogP ≤ 552.03
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1018

Analyze 1-[3-(2-bicyclo[2.2.1]heptanylmethoxy)phenyl]butan-1-ol;1-butyl-3-(cyclobutylmethoxy)benzene;1-butyl-3-(cyclopentylmethoxy)benzene;1-(cyclohexylmethoxy)-3-pentan-2-ylbenzene;(1R)-1-[3-(cyclohexylmethoxy)phenyl]-2-ethylbutan-1-ol;(1S,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1S,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopropylmethoxy)phenyl]butan-1-ol;[3-[(2R)-2-methylbutyl]phenoxy]methylcyclooctane with MolForge

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Related Compounds

1-butyl-3-(cyclohexylmethoxy)benzene;(3-butylphenoxy)methylcycloheptane;1-[(3-butylphenoxy)methyl]cyclohexan-1-ol;1-[3-(cycloheptylmethoxy)phenyl]butan-1-ol;1-[3-(cycloheptylmethoxy)phenyl]butan-1-one;1-[3-(cyclohexylmethoxy)phenyl]butan-1-ol;1-[3-(cyclohexylmethoxy)phenyl]butan-2-ol;1-[3-(cyclohexylmethoxy)phenyl]butan-1-one
CID 158362382
[3-[(2S)-2-methylbutyl]phenoxy]methylcycloheptane
CID 126609950
1-butyl-3-(2-ethylbutoxy)benzene;4-[(3-butylphenoxy)methyl]heptan-4-ol;1-butyl-3-(2-propylpentoxy)benzene;1-(cyclohexylmethoxy)-3-propoxybenzene;4-[[3-(1-hydroxybutyl)phenoxy]methyl]heptan-4-ol;(3-propoxyphenoxy)methylcycloheptane;1-[(3-propoxyphenoxy)methyl]cyclohexan-1-ol;1-[3-(2-propylpentoxy)phenyl]butan-1-ol
CID 161338380
1-[3-(cyclohexylmethoxy)phenyl]propan-1-ol
CID 58097643
(1S)-1-[3-(cycloheptylmethoxy)phenyl]butan-1-ol;(1R,2R)-1-[3-(cycloheptylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclohexylmethoxy)phenyl]butan-1-one;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopentylmethoxy)phenyl]butan-1-one;(1R,2R)-1-[3-(cyclopentylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(2-ethylbutoxy)phenyl]butan-1-one;(1R,2R)-1-[3-(2-ethylbutoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-2-methyl-1-[3-(2-propylpentoxy)phenyl]butan-1-ol;1-[3-(2-propylpentoxy)phenyl]butan-1-one
CID 158616122
(1R,2R)-2-(aminomethyl)-1-[3-(cyclohexylmethoxy)phenyl]pentan-1-ol
CID 174358586
1-butyl-3-(2-ethylbutoxy)benzene;1-[(3-butylphenoxy)methyl]cycloheptan-1-ol;1-butyl-3-(2-propylpentoxy)benzene;6-[3-(cyclohexylmethoxy)phenyl]-6-hydroxyhexan-2-one;1-[[3-(1-hydroxybutyl)phenoxy]methyl]cycloheptan-1-ol;1-[[3-(1-hydroxybutyl)phenoxy]methyl]cyclohexan-1-ol;1-[3-[(1-hydroxycycloheptyl)methoxy]phenyl]butan-1-one;1-[3-[(1-hydroxycyclohexyl)methoxy]phenyl]butan-1-one;methane
CID 158164101
4-[(3-butylphenoxy)methyl]heptan-4-ol;1-(cyclohexylmethoxy)-3-propoxybenzene;4-[[3-(1-hydroxybutyl)phenoxy]methyl]heptan-4-ol;(3-propoxyphenoxy)methylcycloheptane;1-[(3-propoxyphenoxy)methyl]cycloheptan-1-ol;1-[(3-propoxyphenoxy)methyl]cyclohexan-1-ol;4-[(3-propoxyphenoxy)methyl]heptan-4-ol;3-[(3-propoxyphenoxy)methyl]pentan-3-ol;1-propoxy-3-(2-propylpentoxy)benzene
CID 160693710
(1R)-1-[3-(cyclohexylmethoxy)phenyl]-5-iminohexan-1-ol
CID 157299159
(2S)-1-[3-(cyclopentylmethoxy)phenyl]butan-2-ol
CID 69097479
[3-[(2R)-butan-2-yl]oxyphenoxy]methylcycloheptane;(1R)-1-[3-(cycloheptylmethoxy)phenyl]butan-1-ol;(1S)-1-[3-(cyclohexylmethoxy)phenyl]butan-1-ol;(1R)-1-[3-(cyclohexylmethoxy)phenyl]butan-1-ol;(1S)-1-[3-(cyclopentylmethoxy)phenyl]butan-1-ol;(1R)-1-[3-(cyclopentylmethoxy)phenyl]butan-1-ol;(1S)-1-[3-(2-ethylbutoxy)phenyl]butan-1-ol;(1R)-1-[3-(2-ethylbutoxy)phenyl]butan-1-ol;(1S)-1-[3-(2-propylpentoxy)phenyl]butan-1-ol;(1R)-1-[3-(2-propylpentoxy)phenyl]butan-1-ol
CID 158343051
(1R)-3-amino-1-[3-(cyclohexylmethoxy)phenyl]propan-1-ol;ethane
CID 143785909

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-bicyclo[2.2.1]heptanylmethoxy)phenyl]butan-1-ol;1-butyl-3-(cyclobutylmethoxy)benzene;1-butyl-3-(cyclopentylmethoxy)benzene;1-(cyclohexylmethoxy)-3-pentan-2-ylbenzene;(1R)-1-[3-(cyclohexylmethoxy)phenyl]-2-ethylbutan-1-ol;(1S,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1S,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopropylmethoxy)phenyl]butan-1-ol;[3-[(2R)-2-methylbutyl]phenoxy]methylcyclooctane?
The IUPAC name of 1-[3-(2-bicyclo[2.2.1]heptanylmethoxy)phenyl]butan-1-ol;1-butyl-3-(cyclobutylmethoxy)benzene;1-butyl-3-(cyclopentylmethoxy)benzene;1-(cyclohexylmethoxy)-3-pentan-2-ylbenzene;(1R)-1-[3-(cyclohexylmethoxy)phenyl]-2-ethylbutan-1-ol;(1S,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1S,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopropylmethoxy)phenyl]butan-1-ol;[3-[(2R)-2-methylbutyl]phenoxy]methylcyclooctane (CID 162195199) is 1-[3-(2-bicyclo[2.2.1]heptanylmethoxy)phenyl]butan-1-ol;1-butyl-3-(cyclobutylmethoxy)benzene;1-butyl-3-(cyclopentylmethoxy)benzene;1-(cyclohexylmethoxy)-3-pentan-2-ylbenzene;(1R)-1-[3-(cyclohexylmethoxy)phenyl]-2-ethylbutan-1-ol;(1S,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1S,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopropylmethoxy)phenyl]butan-1-ol;[3-[(2R)-2-methylbutyl]phenoxy]methylcyclooctane.
What is the SMILES notation for 1-[3-(2-bicyclo[2.2.1]heptanylmethoxy)phenyl]butan-1-ol;1-butyl-3-(cyclobutylmethoxy)benzene;1-butyl-3-(cyclopentylmethoxy)benzene;1-(cyclohexylmethoxy)-3-pentan-2-ylbenzene;(1R)-1-[3-(cyclohexylmethoxy)phenyl]-2-ethylbutan-1-ol;(1S,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1S,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopropylmethoxy)phenyl]butan-1-ol;[3-[(2R)-2-methylbutyl]phenoxy]methylcyclooctane?
The canonical SMILES for 1-[3-(2-bicyclo[2.2.1]heptanylmethoxy)phenyl]butan-1-ol;1-butyl-3-(cyclobutylmethoxy)benzene;1-butyl-3-(cyclopentylmethoxy)benzene;1-(cyclohexylmethoxy)-3-pentan-2-ylbenzene;(1R)-1-[3-(cyclohexylmethoxy)phenyl]-2-ethylbutan-1-ol;(1S,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1S,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopropylmethoxy)phenyl]butan-1-ol;[3-[(2R)-2-methylbutyl]phenoxy]methylcyclooctane is CCC(CC)[C@@H](O)c1cccc(OCC2CCCCC2)c1.CCCC(C)c1cccc(OCC2CCCCC2)c1.CCCC(O)c1cccc(OCC2CC2)c1.CCCC(O)c1cccc(OCC2CC3CCC2C3)c1.CCCCc1cccc(OCC2CCC2)c1.CCCCc1cccc(OCC2CCCC2)c1.CC[C@@H](C)Cc1cccc(OCC2CCCCCCC2)c1.CC[C@@H](C)[C@@H](O)c1cccc(OCC2CCCCC2)c1.CC[C@@H](C)[C@H](O)c1cccc(OCC2CCCCC2)c1.CC[C@H](C)[C@@H](O)c1cccc(OCC2CCCCC2)c1.CC[C@H](C)[C@H](O)c1cccc(OCC2CCCCC2)c1.
What is the InChIKey of 1-[3-(2-bicyclo[2.2.1]heptanylmethoxy)phenyl]butan-1-ol;1-butyl-3-(cyclobutylmethoxy)benzene;1-butyl-3-(cyclopentylmethoxy)benzene;1-(cyclohexylmethoxy)-3-pentan-2-ylbenzene;(1R)-1-[3-(cyclohexylmethoxy)phenyl]-2-ethylbutan-1-ol;(1S,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1S,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopropylmethoxy)phenyl]butan-1-ol;[3-[(2R)-2-methylbutyl]phenoxy]methylcyclooctane?
The InChIKey is ZQVPPHGZTMIWID-PHRUSRNHSA-N. The full InChI is InChI=1S/C20H32O.C19H30O2.C18H26O2.4C18H28O2.C18H28O.C16H24O.C15H22O.C14H20O2/c1-3-17(2)14-19-12-9-13-20(15-19)21-16-18-10-7-5-4-6-8-11-18;1-3-16(4-2)19(20)17-11-8-12-18(13-17)21-14-15-9-6-5-7-10-15;1-2-4-18(19)15-5-3-6-17(11-15)20-12-16-10-13-7-8-14(16)9-13;4*1-3-14(2)18(19)16-10-7-11-17(12-16)20-13-15-8-5-4-6-9-15;1-3-8-15(2)17-11-7-12-18(13-17)19-14-16-9-5-4-6-10-16;1-2-3-7-14-10-6-11-16(12-14)17-13-15-8-4-5-9-15;1-2-3-6-13-7-5-10-15(11-13)16-12-14-8-4-9-14;1-2-4-14(15)12-5-3-6-13(9-12)16-10-11-7-8-11/h9,12-13,15,17-18H,3-8,10-11,14,16H2,1-2H3;8,11-13,15-16,19-20H,3-7,9-10,14H2,1-2H3;3,5-6,11,13-14,16,18-19H,2,4,7-10,12H2,1H3;4*7,10-12,14-15,18-19H,3-6,8-9,13H2,1-2H3;7,11-13,15-16H,3-6,8-10,14H2,1-2H3;6,10-12,15H,2-5,7-9,13H2,1H3;5,7,10-11,14H,2-4,6,8-9,12H2,1H3;3,5-6,9,11,14-15H,2,4,7-8,10H2,1H3/t17-;19-;;2*14-,18+;2*14-,18-;;;;/m11.1010..../s1.
What are the key properties of 1-[3-(2-bicyclo[2.2.1]heptanylmethoxy)phenyl]butan-1-ol;1-butyl-3-(cyclobutylmethoxy)benzene;1-butyl-3-(cyclopentylmethoxy)benzene;1-(cyclohexylmethoxy)-3-pentan-2-ylbenzene;(1R)-1-[3-(cyclohexylmethoxy)phenyl]-2-ethylbutan-1-ol;(1S,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1S,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopropylmethoxy)phenyl]butan-1-ol;[3-[(2R)-2-methylbutyl]phenoxy]methylcyclooctane?
1-[3-(2-bicyclo[2.2.1]heptanylmethoxy)phenyl]butan-1-ol;1-butyl-3-(cyclobutylmethoxy)benzene;1-butyl-3-(cyclopentylmethoxy)benzene;1-(cyclohexylmethoxy)-3-pentan-2-ylbenzene;(1R)-1-[3-(cyclohexylmethoxy)phenyl]-2-ethylbutan-1-ol;(1S,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1S,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopropylmethoxy)phenyl]butan-1-ol;[3-[(2R)-2-methylbutyl]phenoxy]methylcyclooctane has a molecular weight of 2890.45 g/mol, XLogP of 52.03, 67 rotatable bonds, 7 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-bicyclo[2.2.1]heptanylmethoxy)phenyl]butan-1-ol;1-butyl-3-(cyclobutylmethoxy)benzene;1-butyl-3-(cyclopentylmethoxy)benzene;1-(cyclohexylmethoxy)-3-pentan-2-ylbenzene;(1R)-1-[3-(cyclohexylmethoxy)phenyl]-2-ethylbutan-1-ol;(1S,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1S,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2R)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;(1R,2S)-1-[3-(cyclohexylmethoxy)phenyl]-2-methylbutan-1-ol;1-[3-(cyclopropylmethoxy)phenyl]butan-1-ol;[3-[(2R)-2-methylbutyl]phenoxy]methylcyclooctane is sourced from PubChem (CID 162195199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).